SCHEMBL853171

SCHEMBL853171

Cc1cnc2nc(N)[nH]c(=O)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 9/20 0.60
HSD17B10 Q99714 3/20 0.56
ALDH1A1 P00352 3/20 0.52
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KDM4E B2RXH2 2/20 0.51
THRB P10828 2/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
AKR1B1 P15121 1/20 0.49
LMNA P02545 1/20 0.47
GLA P06280 1/20 0.47
PMP22 Q01453 1/20 0.47
MITF O75030 1/20 0.47
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
HBB P68871 1/20 0.47
HIF1A Q16665 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7682917 0.86 AKR1B1 (0.60) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL24811788 0.82 NOS1 (0.60) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL26032957 0.82 SMN1; SMN2 (0.55) NOS1HSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL3528801 0.79 NOS1 (0.57) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL3526051 0.79 NOS1 (0.57) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL22497885 0.79 NOS1 (0.57) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL15164387 0.79 NOS1 (0.39) NOS1HSD17B10ALDH1A1HPGDSMN1; SMN2
SCHEMBL3528782 0.79 NOS1 (0.57) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL12948270 0.79 NOS1 (0.72) NOS1HSD17B10ALDH1A1HPGDKDM4E
SCHEMBL11103935 0.79 NOS1 (0.56) NOS1HSD17B10ALDH1A1HPGDKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 343 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109946412-B Kit for detecting spectrum of humoral pterin and use thereof 上海产业技术研究院 2021-10-15 CN claimed
CN-109946412-A A kind of body fluid pterin spectrum detection kit and its use 上海产业技术研究院 2019-06-28 CN claimed
US-4758312-A Adding colorless electrochemically active compound having positive reduction potential NALCO CHEMICAL COMPANY (US) 1988-07-19 US claimed
US-20230263899-A1 FOLATE RECEPTOR TARGETED NANOPARTICLE DRUG CONJUGATES AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-24 US disclosed
WO-2022272307-A1 BIFUNCTIONAL FOLATE RECEPTOR BINDING COMPOUNDS LYCIA THERAPEUTICS, INC. (US) 2022-12-29 WO disclosed
WO-2022150721-A1 BIFUNCTIONAL FOLATE RECEPTOR BINDING COMPOUNDS LYCIA THERAPEUTICS, INC. (US) 2022-07-14 WO disclosed
EP-3554479-B1 A METHOD FOR PRODUCING BEADS AGRICULTURE AND FOOD DEV AUTHORITY TEAGASC (IE) 2022-02-16 EP disclosed
WO-2021263060-A2 BIFUNCTIONAL BRIDGING COMPOSITIONS FOR VIRAL TRANSDUCTION LYCIA THERAPEUTICS, INC. (US) 2021-12-30 WO disclosed
CN-109946412-B Kit for detecting spectrum of humoral pterin and use thereof 上海产业技术研究院 2021-10-15 CN disclosed
US-20200276127-A1 METHOD FOR PRODUCING BEADS AGRICULTURE AND FOOD DEVELOPMENT AUTHORITY (TEAGASC) (IE) 2020-09-03 US disclosed
EP-3554479-A1 A METHOD FOR PRODUCING BEADS Agriculture and Food Development Authority (TEAGASC) (IE) 2019-10-23 EP disclosed
WO-2001000842-A2 CORYNEBACTERIUM GLUTAMICUM GENES ENCODING PROTEINS INVOLVED IN HOMEOSTASIS AND ADAPTATION BASF AKTIENGESELLSCHAFT (US) 2001-01-04 WO disclosed
WO-2001000844-A2 CORYNEBACTERIUM GLUTAMICUM GENES ENCODING PROTEINS INVOLVED IN CARBON METABOLISM AND ENERGY PRODUCTION BASF AKTIENGESELLSCHAFT (US) 2001-01-04 WO disclosed
WO-2001000804-A2 CORYNEBACTERIUM GLUTAMICUM GENES ENCODING STRESS, RESISTANCE AND TOLERANCE PROTEINS BASF AKTIENGESELLSCHAFT (US) 2001-01-04 WO disclosed
WO-2000004163-A9 TETRAHYDROFOLATE METABOLISM ENZYMES DU PONT (US) 2000-07-20 WO disclosed
WO-2000023448-A1 NOVEL PTERIN ANTINEOPLASTIC AGENTS MOHENO PHILLIP B B (US) 2000-04-27 WO disclosed
WO-2000004163-A1 TETRAHYDROFOLATE METABOLISM ENZYMES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-01-27 WO disclosed
US-4758312-A Adding colorless electrochemically active compound having positive reduction potential NALCO CHEMICAL COMPANY (US) 1988-07-19 US disclosed
EP-0237738-A2 Method for in situ corrosion detection using electrochemically active compounds NALCO CHEMICAL COMPANY (US) 1987-09-23 EP disclosed
US-4683035-A Method for in situ corrosion detection using electrochemically active compounds NALCO CHEMICAL COMPANY (US) 1987-07-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230263899-A1 FOLATE RECEPTOR TARGETED NANOPARTICLE DRUG CONJUGATES AND USES THEREOF FOLR1, FOLR2, DHFR NOS1 3684/4885HSD17B10 3064/4885ALDH1A1 1046/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.